| SpectraBase Spectrum ID |
97H1XThag2i |
| Name |
ethanol, 2-[[4-(4-tricyclo[3.3.1.1~3,7~]dec-1-yl-1-piperazinyl)-6-[[4-(trifluoromethoxy)phenyl]amino]-1,3,5-triazin-2-yl]amino]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
533.272607850 u |
| Formula |
C26H34F3N7O2 |
| InChI |
InChI=1S/C26H34F3N7O2/c27-26(28,29)38-21-3-1-20(2-4-21)31-23-32-22(30-5-10-37)33-24(34-23)35-6-8-36(9-7-35)25-14-17-11-18(15-25)13-19(12-17)16-25/h1-4,17-19,37H,5-16H2,(H2,30,31,32,33,34)/t17-,18+,19-,25- |
| InChIKey |
AKPRRTFOJQTPCA-DXSJEHQWSA-N |
| Molecular Weight |
533.600 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16771 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11260432; Lab Info: AS; Lab Number: AS-X000105 |
![2-[[4-[4-(1-adamantyl)piperazin-1-yl]-6-[4-(trifluoromethoxy)anilino]-1,3,5-triazin-2-yl]amino]ethanol](/api/spectrum/97H1XThag2i/structure.png?h=300&w=458 "2-[[4-[4-(1-adamantyl)piperazin-1-yl]-6-[4-(trifluoromethoxy)anilino]-1,3,5-triazin-2-yl]amino]ethanol")
